SCHEMBL4627699

SCHEMBL4627699

Cc1cn([C@H]2CC[C@@H](COC(c3ccc(OC(=O)OCC(C)c4ccccc4[N+](=O)[O-])cc3)(c3ccc(OC(=O)OCC(C)c4ccccc4[N+](=O)[O-])cc3)c3ccc(OC(=O)OCC(C)c4ccccc4[N+](=O)[O-])cc3)O2)c(=O)[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.39
TK1 P04183 4/20 0.34
RNASE1 P07998 1/20 0.34
TERT O14746 1/20 0.33
ABCG2 Q9UNQ0 3/20 0.32
ABCB1 P08183 1/20 0.32
TK2 O00142 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4627707 0.86 TYMS (0.41)
SCHEMBL4627709 0.83 TYMP (0.46) TK1TERT
SCHEMBL6891978 0.77 POLB (0.47) BCHE
SCHEMBL13666501 0.77 POLB (0.47) BCHE
SCHEMBL2521252 0.77 POLB (0.47) BCHE
SCHEMBL4689416 0.76 TK1 (0.33) TK1RNASE1TK2
SCHEMBL7643615 0.76 RNASE1 (0.51) TK1RNASE1ABCG2ABCB1
SCHEMBL1697175 0.75 BCHE (0.48) BCHETK1TK2
SCHEMBL5055957 0.75 BCHE (0.48) BCHETK1TK2
SCHEMBL15827264 0.75 BCHE (0.48) BCHETK1TK2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1401851-B1 TWO-STAGE PROTECTIVE GROUPS FOR THE SYNTHESIS OF BIOPOLYMERS FEBIT BIOTECH GMBH (DE) 2008-07-02 EP disclosed
US-7355036-B2 Two-stage protective groups for the synthesis of biopolymers FEBIT AG (DE) 2008-04-08 US disclosed
US-20040197851-A1 Two-stage protective groups for the synthesis of biopolymers MR. CHRISTOPHER SEAGON, ESQ. (DE) 2004-10-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040197851-A1 Two-stage protective groups for the synthesis of biopolymers CTRB2, OGG1, CPB2 BCHE 588/4885TK1 3346/4885RNASE1 863/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.